| SpectraBase Spectrum ID |
Kq8asuRZDdG |
| Name |
trans-2-Cyclohexyl-3-(4-cyanophenyl)-4-phenyl-1,2-thiazetizine 1,1-dioxide |
| Alternate Name(s) |
4-[(3S,4S)-2-cyclohexyl-1,1-dioxido-4-phenyl-1,2-thiazetidin-3-yl]benzonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22N2O2S |
| InChI |
InChI=1S/C21H22N2O2S/c22-15-16-11-13-17(14-12-16)20-21(18-7-3-1-4-8-18)26(24,25)23(20)19-9-5-2-6-10-19/h1,3-4,7-8,11-14,19-21H,2,5-6,9-10H2/t20-,21-/m0/s1 |
| InChIKey |
WCVWIDDRDGEQBL-SFTDATJTSA-N |
| Molecular Weight |
366.479 g/mol |
| SMILES |
C1(N2S([C@]([C@@]2(c2ccc(C#N)cc2)[H])(c2ccccc2)[H])(=O)=O)CCCCC1 |
| SPLASH |
splash10-014i-0029000000-3c62a9cfe61a323cb782 |
| Source of Spectrum |
F-54-8958-10 |
| Wiley ID |
807927 |
